Dodecyl methanesulfonate
Basic information
- CAS
51323-71-8- Standard SMILES
CCCCCCCCCCCCOS(C)(=O)=O- InChIKey
RUFILLDBEINNQV-UHFFFAOYSA-N- Molecular formula
- C13H28O3S
- Average molar mass
- 264.43 g/mol
- Monoisotopic mass
- 264.17591592
Names & identifiers
- Preferred name
- Dodecyl methanesulfonate
- IUPAC
- dodecyl methanesulfonate
- English name
- Dodecylmethanesulfonate
- Molecular formula
- C13H28O3S
- Molecular weight
- 264.42
Names & synonyms
Dodecyl methanesulfonate51323-71-8DTXSID50289540RefChem:590305DTXCID00240686665-084-9dodecyl methane sulfonateMethanesulfonic acid,dodecyl esterMethanesulfonic acid dodecyl esterDODECYLMETHANESULFONATEMFCD00025059NSC61860
Show more names
DODECYLMETHANESULPHONATE
n-Dodecyl methanesulfonateNCIOpen2_002614CHEMBL23307SCHEMBL2223590NSC-61860AKOS024336123BP-43358SY488859
Database identifiers
- CAS
51323-71-8- PubChem CID
- 247385
- DTXSID
DTXSID50289540- ChEMBL
CHEMBL23307- EC Number
- 665-084-9
- Nikkaji
- J400.650J
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 12
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 242
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 315 · H315-H318-H413-H335-H317
- Precautionary statements
- 280 · P280-P305+P351+P338-P310-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P272, P273, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P333+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H315-H318-H413-H335-H317
- Precautionary statements
- P280-P305+P351+P338-P310-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Applications
UsesDodecyl methane sulfonate is an ester product.
Upstream & downstream products
Downstream products
Suppliers
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Related reactions
0 records
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Compound notes
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